Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NR1H2 | P55055 | 14/20 | 0.38 |
| ▸ | NR1H3 | Q13133 | 13/20 | 0.38 |
| ▸ | PPARA | Q07869 | 8/20 | 0.38 |
| ▸ | PPARG | P37231 | 7/20 | 0.38 |
| ▸ | PPARD | Q03181 | 7/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.37 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | HPGD | P15428 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
| ▸ | PDE5A | O76074 | 3/20 | 0.35 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6100664 | 0.78 | PPARG (0.60) | NR1H2NR1H3PPARAPPARGPPARD | |
| SCHEMBL27776122 | 0.76 | ALDH1A1 (0.57) | MEN1ALDH1A1LMNAHPGDKMT2A | |
| SCHEMBL9118750 | 0.75 | MAOB (0.47) | PPARAPPARGPPARDLMNAPDE5A | |
| SCHEMBL6405507 | 0.73 | PPARG (0.39) | NR1H2NR1H3PPARAPPARGPPARD | |
| SCHEMBL9122729 | 0.72 | PPARA (0.43) | NR1H2NR1H3PPARAPPARGPPARD | |
| SCHEMBL7355758 | 0.68 | CA2 (0.41) | PPARAPPARG | |
| SCHEMBL9121837 | 0.68 | LMNA (0.48) | MEN1ALDH1A1LMNAHPGDKMT2A | |
| SCHEMBL9118918 | 0.68 | LTB4R (0.57) | — | |
| SCHEMBL4927376 | 0.67 | ALPL (0.49) | ALDH1A1LMNAHPGDKMT2A | |
| SCHEMBL1500164 | 0.66 | KDM4E (0.59) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5434186-A | Antiinflammatory agents | HOFFMANN-LA ROCHE INC. (US) | 1995-07-18 | — | — | US | disclosed |
| US-5273999-A | A 4-keto-boroalkyleneoxychroman or 2,3-dihydrobenzofuran derivative | HOFFMANN-LA ROCHE INC. (US) | 1993-12-28 | — | — | US | disclosed |
| EP-0531823-A1 | Bicyclic carboxylic acid derivatives as anti-inflammatory agents | F. HOFFMANN-LA ROCHE AG (CH) | 1993-03-17 | — | — | EP | disclosed |